SCHEMBL6253936

SCHEMBL6253936

CCOc1cccc(Cn2cc(N3CCN(C(=O)[C@H]4CC[C@H](CN(C)C)CC4)CC3)cn2)c1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.44
▸ ALDH1A1 P00352 4/20 0.44
▸ KDM4E B2RXH2 3/20 0.44
▸ HTT P42858 1/20 0.44
▸ MAPT P10636 7/20 0.42
▸ POLB P06746 1/20 0.40
▸ FAAH O00519 1/20 0.40
▸ MAPK1 P28482 3/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ TP53 P04637 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ KMT2A Q03164 2/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ KLKB1 P03952 1/20 0.37
▸ TLR9 Q9NR96 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6267847 0.88 LMNA (0.40) LMNAALDH1A1KDM4EHTTMAPT
SCHEMBL27463399 0.88 LMNA (0.40) LMNAALDH1A1KDM4EHTTMAPT
SCHEMBL27639303 0.87 KDM4E (0.42) LMNAALDH1A1KDM4EHTTMAPT
SCHEMBL27489532 0.87 KDM4E (0.42) LMNAALDH1A1KDM4EHTTMAPT
SCHEMBL27463835 0.87 KDM4E (0.39) LMNAALDH1A1KDM4EHTTMAPT
SCHEMBL6269923 0.86 LMNA (0.45) LMNAALDH1A1KDM4EHTTMAPT
SCHEMBL27441898 0.86 ALDH1A1 (0.45) LMNAALDH1A1KDM4EHTTMAPT
SCHEMBL27441895 0.86 ALDH1A1 (0.45) LMNAALDH1A1KDM4EHTTMAPT
SCHEMBL27639346 0.85 LMNA (0.46) LMNAALDH1A1KDM4EHTTMAPT
SCHEMBL6268901 0.85 LMNA (0.44) LMNAALDH1A1KDM4EHTTMAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1585481-A2 PYRAZOLOPYRIMIDINE COMPOUND AND PROCESS FOR PREPARING THE SAME TANABE SEIYAKU CO., LTD. (JP) 2005-10-19 — — EP claimed
WO-2004064721-A2 A PYRAZOLOPYRIMIDINE COMPOUND AND A PROCESS FOR PREPARING THE SAME TANABE SEIYAKU CO., LTD. (JP) 2004-08-05 — — WO claimed
EP-1585481-A2 PYRAZOLOPYRIMIDINE COMPOUND AND PROCESS FOR PREPARING THE SAME TANABE SEIYAKU CO., LTD. (JP) 2005-10-19 — — EP disclosed
WO-2004064721-A2 A PYRAZOLOPYRIMIDINE COMPOUND AND A PROCESS FOR PREPARING THE SAME TANABE SEIYAKU CO., LTD. (JP) 2004-08-05 — — WO disclosed
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